3-(hydroxymethyl)-1-methylquinolin-2(1H)-one
TL;DR: 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one (CAS 114561-15-8) is a chemical compound with molecular formula C11H11NO2 and molecular weight 189.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(hydroxymethyl)-1-methylquinolin-2-one
Also Known As: 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one, 3-(hydroxymethyl)-1-methylquinolin-2-one, 3-(hydroxymethyl)-1-methyl-2(1H)-Quinolinone, 9495AC, 2(1H)-Quinolinone, 3-(hydroxymethyl)-1-methyl-
Technical Specifications
| Molecular Formula | C11H11NO2 |
| Molecular Weight | 189.07898 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.07898 Da |
| Heavy Atoms | 14 |
| Complexity | 272.0 |
| SMILES | CN1C2=CC=CC=C2C=C(C1=O)CO |
| InChIKey | RZVICXIGFUNOSW-UHFFFAOYSA-N |
Chemical Property Profile of 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one
Property Insights of 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one. With a topological polar surface area (TPSA) of 40.5 Ų, 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one?
The CAS number of 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one is 114561-15-8.
What is the molecular formula of 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one?
The molecular formula of 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one is C11H11NO2.
What is the molecular weight of 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one?
The molecular weight of 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one is 189.07898 g/mol.
Where can I buy 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one?
You can request a quote for 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one?
Yes, CoreyChem provides custom synthesis services for 3-(hydroxymethyl)-1-methylquinolin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.